Vitas-M small molecule compound

di-tert-butyl 4-[3-(4-ethoxy-3-fluorophenyl)-1-phenyl-1H-pyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate

Catalog ID
STK810461
SMILES CCOc1ccc(cc1F)c1nn(cc1C1C(=C(C)NC(=C1C(=O)OC(C)(C)C)C)C(=O)OC(C)(C)C)c1ccccc1

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C34H40FN3O5 MW 589.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H40FN3O5/c1-10-41-26-17-16-22(18-25(26)35)30-24(19-38(37-30)23-14-12-11-13-15-23)29-27(31(39)42-33(4,5)6)20(2)36-21(3)28(29)32(40)43-34(7,8)9/h11-19,29,36H,10H2,1-9H3
InChIKey
PKWLJINNSWKPCL-UHFFFAOYSA-N
Synonyms

CCOC1=C(C=C(C=C1)C2=NN(C=C2C3C(=C(NC(=C3C(=O)OC(C)(C)C)C)C)C(=O)OC(C)(C)C)C4=CC=CC=C4)F
DI(TERTBUTYL)4(3(4ETHOXY3FLUOROPHENYL)1PHENYL1HPYRAZOL4YL)26DIMETHYL14DIHYDROPYRIDINE35DICARBOXYLATE
ditertbutyl4(3(4ethoxy3fluorophenyl)1phenyl1Hpyrazol4yl)26dimethyl14dihydropyridine35dicarboxylate
DITERTBUTYL4(3(4ETHOXY3FLUOROPHENYL)1PHENYLPYRAZOL4YL)26DIMETHYL14DIHYDROPYRIDINE35DICARBOXYLATE
InChI=1SC34H40FN3O5c1104126171622(1825(26)35)3024(1938(3730)23141211131523)2927(31(39)4233(45)6)20(2)3621(3)28(29)32(40)4334(78)9h11192936H10H219H3
MFCD03696012
ZINC000098043588
ZINC98043588

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Available files

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